Structure of PDB 6sr9 Chain A Binding Site BS02

Receptor Information
>6sr9 Chain A (length=235) Species: 717944 (Trametes versicolor FP-101664 SS1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PERITLYTAKICPFAQRVEIALHEAKAHHNVEQFQIDLQNKPEWYAPKVN
PASKVPAIAYGGPHVPPDQPSPESIKLAESLILVEFVADLFPHSHLLPHD
PVKRAQARFFIDGVSTKFIPAWHAFSQGKSSEEDFLTAVEHLQALLPESG
FAVGAYSIADVALTPFLGRARVTLKEDLGGYPRGEGPRVLAVLTSGTGRL
ARFGKYAQDLLARESFQATFDEAYITERYKARFAD
Ligand information
Ligand IDEZE
InChIInChI=1S/C14H12O4/c15-11-4-3-10(14(18)8-11)2-1-9-5-12(16)7-13(17)6-9/h1-8,15-18H/b2-1+
InChIKeyPDHAOJSHSJQANO-OWOJBTEDSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Oc1ccc(\C=C\c2cc(O)cc(O)c2)c(O)c1
OpenEye OEToolkits 2.0.6c1cc(c(cc1O)O)/C=C/c2cc(cc(c2)O)O
CACTVS 3.385Oc1ccc(C=Cc2cc(O)cc(O)c2)c(O)c1
OpenEye OEToolkits 2.0.6c1cc(c(cc1O)O)C=Cc2cc(cc(c2)O)O
FormulaC14 H12 O4
Nametrans-oxyresveratrol
ChEMBLCHEMBL43065
DrugBank
ZINCZINC000000899161
PDB chain6sr9 Chain A Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6sr9 Diversity of Omega Glutathione Transferases in mushroom-forming fungi revealed by phylogenetic, transcriptomic, biochemical and structural approaches.
Resolution1.845 Å
Binding residue
(original residue number in PDB)		P14 F15 L39 Q40 H124
Binding residue
(residue number reindexed from 1)		P13 F14 L38 Q39 H123
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Cellular Component
External links
PDB RCSB:6sr9, PDBe:6sr9, PDBj:6sr9
PDBsum6sr9
PubMed33450403
UniProtR7S7J5

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